data_5YIQ

_pdbx_vrpt_database.id    PDB
_pdbx_vrpt_database.code  5YIQ
#
_pdbx_vrpt_exptl.ordinal  1
_pdbx_vrpt_exptl.method   x-ray
#
_pdbx_vrpt_summary.entry_id                    5YIQ
_pdbx_vrpt_summary.PDB_deposition_date         2017-10-06
_pdbx_vrpt_summary.PDB_revision_number         4
_pdbx_vrpt_summary.PDB_revision_date           2023-11-22
_pdbx_vrpt_summary.report_creation_date        2023-11-13:15:06
_pdbx_vrpt_summary.attempted_validation_steps  molprobity,validation-pack,xtriage,eds,mogul,percentiles,writexml,writecif,writepdf
_pdbx_vrpt_summary.ligands_for_buster_report   N
#
loop_
_pdbx_vrpt_entity.id
_pdbx_vrpt_entity.type
_pdbx_vrpt_entity.description
1  polymer      "Microtubule-associated proteins 1A/1B light chain 3B"  
2  polymer      Ankyrin-3  
3  non-polymer  "ZINC ION"  
4  water        water  
#
loop_
_pdbx_vrpt_asym.label_asym_id
_pdbx_vrpt_asym.entity_id
A  1  
B  2  
C  3  
D  3  
E  3  
F  3  
G  4  
#
loop_
_pdbx_vrpt_percentile_list.id
_pdbx_vrpt_percentile_list.range
_pdbx_vrpt_percentile_list.exp_method
1  all  x-ray  
2  2.6  x-ray  
#
loop_
_pdbx_vrpt_percentile_type.id
_pdbx_vrpt_percentile_type.type
1  all_atom_clashscore           
2  Ramachandran_outlier_percent  
3  rotamer_outliers_percent      
4  RSRZ_outliers_percent         
5  R_value_R_free                
#
loop_
_pdbx_vrpt_percentile_conditions.id
_pdbx_vrpt_percentile_conditions.percentile_list_id
_pdbx_vrpt_percentile_conditions.type_id
_pdbx_vrpt_percentile_conditions.rank
_pdbx_vrpt_percentile_conditions.number_entries_total
_pdbx_vrpt_percentile_conditions.res_high
_pdbx_vrpt_percentile_conditions.res_low
 1  1  1   61.79  141614     ?     ?  
 2  2  1   78.31    3518  2.60  2.60  
 3  1  2  100.00  138981     ?     ?  
 4  2  2  100.00    3455  2.60  2.60  
 5  1  3   34.70  138945     ?     ?  
 6  2  3   60.87    3455  2.60  2.60  
 7  1  4  100.00  127900     ?     ?  
 8  2  4  100.00    3104  2.60  2.60  
 9  1  5   27.11  130704     ?     ?  
10  2  5   51.83    3163  2.60  2.60  
#
loop_
_pdbx_vrpt_percentile_entity_view.ordinal
_pdbx_vrpt_percentile_entity_view.conditions_id
_pdbx_vrpt_percentile_entity_view.type_id
_pdbx_vrpt_percentile_entity_view.label_asym_id
_pdbx_vrpt_percentile_entity_view.PDB_model_num
_pdbx_vrpt_percentile_entity_view.entity_id
_pdbx_vrpt_percentile_entity_view.auth_asym_id
_pdbx_vrpt_percentile_entity_view.rank
 1  3  2  A  1  1  A  100.00  
 2  4  2  A  1  1  A  100.00  
 3  5  3  A  1  1  A   39.70  
 4  6  3  A  1  1  A   66.25  
 5  7  4  A  1  1  A  100.00  
 6  8  4  A  1  1  A  100.00  
 7  3  2  B  1  2  D  100.00  
 8  4  2  B  1  2  D  100.00  
 9  5  3  B  1  2  D   12.54  
10  6  3  B  1  2  D   25.12  
11  7  4  B  1  2  D  100.00  
12  8  4  B  1  2  D  100.00  
#
loop_
_pdbx_vrpt_summary_entity_geometry.ordinal
_pdbx_vrpt_summary_entity_geometry.PDB_model_num
_pdbx_vrpt_summary_entity_geometry.entity_id
_pdbx_vrpt_summary_entity_geometry.label_asym_id
_pdbx_vrpt_summary_entity_geometry.auth_asym_id
_pdbx_vrpt_summary_entity_geometry.angles_RMSZ
_pdbx_vrpt_summary_entity_geometry.bonds_RMSZ
_pdbx_vrpt_summary_entity_geometry.num_bonds_RMSZ
_pdbx_vrpt_summary_entity_geometry.num_angles_RMSZ
1  1  1  A  A  0.70  0.43  935  1266  
2  1  2  B  D  0.67  0.54  135   181  
#
_pdbx_vrpt_summary_geometry.ordinal                        1
_pdbx_vrpt_summary_geometry.percent_ramachandran_outliers  0.00
_pdbx_vrpt_summary_geometry.percent_rotamer_outliers       3.64
_pdbx_vrpt_summary_geometry.clashscore                     4.38
_pdbx_vrpt_summary_geometry.num_H_reduce                   1001
_pdbx_vrpt_summary_geometry.num_bonds_RMSZ                 1070
_pdbx_vrpt_summary_geometry.bonds_RMSZ                     0.44
_pdbx_vrpt_summary_geometry.num_angles_RMSZ                1447
_pdbx_vrpt_summary_geometry.angles_RMSZ                    0.69
#
_pdbx_vrpt_summary_diffraction.exp_method                x-ray
_pdbx_vrpt_summary_diffraction.ordinal                   1
_pdbx_vrpt_summary_diffraction.Babinet_b                 95.102
_pdbx_vrpt_summary_diffraction.bulk_solvent_b            32.002
_pdbx_vrpt_summary_diffraction.Wilson_B_estimate         53.457
_pdbx_vrpt_summary_diffraction.I_over_sigma              2.33(2.61A)
_pdbx_vrpt_summary_diffraction.num_miller_indices        6367
_pdbx_vrpt_summary_diffraction.Babinet_k                 0.030
_pdbx_vrpt_summary_diffraction.bulk_solvent_k            0.325
_pdbx_vrpt_summary_diffraction.Padilla_Yeates_L_mean     0.507
_pdbx_vrpt_summary_diffraction.Padilla_Yeates_L2_mean    0.346
_pdbx_vrpt_summary_diffraction.Fo_Fc_correlation         0.945
_pdbx_vrpt_summary_diffraction.DCC_R                     0.22
_pdbx_vrpt_summary_diffraction.DCC_Rfree                 0.26
_pdbx_vrpt_summary_diffraction.EDS_R                     0.22
_pdbx_vrpt_summary_diffraction.EDS_res_high              2.60
_pdbx_vrpt_summary_diffraction.EDS_res_low               27.17
_pdbx_vrpt_summary_diffraction.Wilson_B_aniso            "[54.669,54.669,50.609,-0.000,0.000,0.000]"
_pdbx_vrpt_summary_diffraction.data_anisotropy           0.076
_pdbx_vrpt_summary_diffraction.trans_NCS_details         "The largest off-origin peak in the Patterson function is 5.58% of the height of the origin peak. No significant pseudotranslation is detected."
_pdbx_vrpt_summary_diffraction.B_factor_type             FULL
_pdbx_vrpt_summary_diffraction.acentric_outliers         1
_pdbx_vrpt_summary_diffraction.centric_outliers          1
_pdbx_vrpt_summary_diffraction.data_completeness         99.39
_pdbx_vrpt_summary_diffraction.number_reflns_R_free      314
_pdbx_vrpt_summary_diffraction.percent_free_reflections  4.93
_pdbx_vrpt_summary_diffraction.percent_RSRZ_outliers     0.00
_pdbx_vrpt_summary_diffraction.PDB_resolution_high       2.60
_pdbx_vrpt_summary_diffraction.PDB_resolution_low        50.00
_pdbx_vrpt_summary_diffraction.PDB_R                     0.22
_pdbx_vrpt_summary_diffraction.PDB_Rfree                 0.26
#
loop_
_pdbx_vrpt_model_instance.id
_pdbx_vrpt_model_instance.PDB_model_num
_pdbx_vrpt_model_instance.entity_id
_pdbx_vrpt_model_instance.label_asym_id
_pdbx_vrpt_model_instance.label_seq_id
_pdbx_vrpt_model_instance.label_comp_id
_pdbx_vrpt_model_instance.auth_asym_id
_pdbx_vrpt_model_instance.auth_seq_id
_pdbx_vrpt_model_instance.label_alt_id
_pdbx_vrpt_model_instance.PDB_ins_code
_pdbx_vrpt_model_instance.count_clashes
  1  1  1  A    5  LYS  A    5  .  ?        ?  
  2  1  1  A    6  THR  A    6  .  ?        ?  
  3  1  1  A    7  PHE  A    7  .  ?        ?  
  4  1  1  A    8  LYS  A    8  .  ?        ?  
  5  1  1  A    9  GLN  A    9  .  ?        ?  
  6  1  1  A   10  ARG  A   10  .  ?        ?  
  7  1  1  A   11  ARG  A   11  .  ?        ?  
  8  1  1  A   12  SER  A   12  .  ?        ?  
  9  1  1  A   13  PHE  A   13  .  ?        ?  
 10  1  1  A   14  GLU  A   14  .  ?        ?  
 11  1  1  A   15  GLN  A   15  .  ?        ?  
 12  1  1  A   16  ARG  A   16  .  ?        ?  
 13  1  1  A   17  VAL  A   17  .  ?        ?  
 14  1  1  A   18  GLU  A   18  .  ?        ?  
 15  1  1  A   19  ASP  A   19  .  ?        ?  
 16  1  1  A   20  VAL  A   20  .  ?        ?  
 17  1  1  A   21  ARG  A   21  .  ?        ?  
 18  1  1  A   22  LEU  A   22  .  ?        ?  
 19  1  1  A   23  ILE  A   23  .  ?        ?  
 20  1  1  A   24  ARG  A   24  .  ?        1  
 21  1  1  A   25  GLU  A   25  .  ?        ?  
 22  1  1  A   26  GLN  A   26  .  ?        ?  
 23  1  1  A   27  HIS  A   27  .  ?        ?  
 24  1  1  A   28  PRO  A   28  .  ?        ?  
 25  1  1  A   29  THR  A   29  .  ?        ?  
 26  1  1  A   30  LYS  A   30  .  ?        1  
 27  1  1  A   31  ILE  A   31  .  ?        ?  
 28  1  1  A   32  PRO  A   32  .  ?        ?  
 29  1  1  A   33  VAL  A   33  .  ?        ?  
 30  1  1  A   34  ILE  A   34  .  ?        ?  
 31  1  1  A   35  ILE  A   35  .  ?        ?  
 32  1  1  A   36  GLU  A   36  .  ?        1  
 33  1  1  A   37  ARG  A   37  .  ?        ?  
 34  1  1  A   38  TYR  A   38  .  ?        ?  
 35  1  1  A   39  LYS  A   39  .  ?        ?  
 36  1  1  A   40  GLY  A   40  .  ?        ?  
 37  1  1  A   41  GLU  A   41  .  ?        ?  
 38  1  1  A   42  LYS  A   42  .  ?        ?  
 39  1  1  A   43  GLN  A   43  .  ?        ?  
 40  1  1  A   44  LEU  A   44  .  ?        ?  
 41  1  1  A   45  PRO  A   45  .  ?        ?  
 42  1  1  A   46  VAL  A   46  .  ?        ?  
 43  1  1  A   47  LEU  A   47  .  ?        ?  
 44  1  1  A   48  ASP  A   48  .  ?        ?  
 45  1  1  A   49  LYS  A   49  .  ?        ?  
 46  1  1  A   50  THR  A   50  .  ?        ?  
 47  1  1  A   51  LYS  A   51  .  ?        ?  
 48  1  1  A   52  PHE  A   52  .  ?        ?  
 49  1  1  A   53  LEU  A   53  .  ?        ?  
 50  1  1  A   54  VAL  A   54  .  ?        3  
 51  1  1  A   55  PRO  A   55  .  ?        ?  
 52  1  1  A   56  ASP  A   56  .  ?        ?  
 53  1  1  A   57  HIS  A   57  .  ?        ?  
 54  1  1  A   58  VAL  A   58  .  ?        ?  
 55  1  1  A   59  ASN  A   59  .  ?        ?  
 56  1  1  A   60  MET  A   60  .  ?        ?  
 57  1  1  A   61  SER  A   61  .  ?        ?  
 58  1  1  A   62  GLU  A   62  .  ?        ?  
 59  1  1  A   63  LEU  A   63  .  ?        ?  
 60  1  1  A   64  ILE  A   64  .  ?        2  
 61  1  1  A   65  LYS  A   65  .  ?        ?  
 62  1  1  A   66  ILE  A   66  .  ?        ?  
 63  1  1  A   67  ILE  A   67  .  ?        ?  
 64  1  1  A   68  ARG  A   68  .  ?        1  
 65  1  1  A   69  ARG  A   69  .  ?        ?  
 66  1  1  A   70  ARG  A   70  .  ?        ?  
 67  1  1  A   71  LEU  A   71  .  ?        1  
 68  1  1  A   72  GLN  A   72  .  ?        ?  
 69  1  1  A   73  LEU  A   73  .  ?        1  
 70  1  1  A   74  ASN  A   74  .  ?        ?  
 71  1  1  A   75  ALA  A   75  .  ?        ?  
 72  1  1  A   76  ASN  A   76  .  ?        ?  
 73  1  1  A   77  GLN  A   77  .  ?        1  
 74  1  1  A   78  ALA  A   78  .  ?        ?  
 75  1  1  A   79  PHE  A   79  .  ?        ?  
 76  1  1  A   80  PHE  A   80  .  ?        ?  
 77  1  1  A   81  LEU  A   81  .  ?        2  
 78  1  1  A   82  LEU  A   82  .  ?        ?  
 79  1  1  A   83  VAL  A   83  .  ?        ?  
 80  1  1  A   84  ASN  A   84  .  ?        ?  
 81  1  1  A   85  GLY  A   85  .  ?        ?  
 82  1  1  A   86  HIS  A   86  .  ?        ?  
 83  1  1  A   87  SER  A   87  .  ?        ?  
 84  1  1  A   88  MET  A   88  .  ?        ?  
 85  1  1  A   89  VAL  A   89  .  ?        ?  
 86  1  1  A   90  SER  A   90  .  ?        ?  
 87  1  1  A   91  VAL  A   91  .  ?        ?  
 88  1  1  A   92  SER  A   92  .  ?        ?  
 89  1  1  A   93  THR  A   93  .  ?        ?  
 90  1  1  A   94  PRO  A   94  .  ?        ?  
 91  1  1  A   95  ILE  A   95  .  ?        3  
 92  1  1  A   96  SER  A   96  .  ?        ?  
 93  1  1  A   97  GLU  A   97  .  ?        ?  
 94  1  1  A   98  VAL  A   98  .  ?        ?  
 95  1  1  A   99  TYR  A   99  .  ?        ?  
 96  1  1  A  100  GLU  A  100  .  ?        ?  
 97  1  1  A  101  SER  A  101  .  ?        ?  
 98  1  1  A  102  GLU  A  102  .  ?        ?  
 99  1  1  A  103  ARG  A  103  .  ?        ?  
100  1  1  A  104  ASP  A  104  .  ?        ?  
101  1  1  A  105  GLU  A  105  .  ?        ?  
102  1  1  A  106  ASP  A  106  .  ?        ?  
103  1  1  A  107  GLY  A  107  .  ?        ?  
104  1  1  A  108  PHE  A  108  .  ?        ?  
105  1  1  A  109  LEU  A  109  .  ?        ?  
106  1  1  A  110  TYR  A  110  .  ?        ?  
107  1  1  A  111  MET  A  111  .  ?        ?  
108  1  1  A  112  VAL  A  112  .  ?        1  
109  1  1  A  113  TYR  A  113  .  ?        ?  
110  1  1  A  114  ALA  A  114  .  ?        ?  
111  1  1  A  115  SER  A  115  .  ?        ?  
112  1  1  A  116  GLN  A  116  .  ?        ?  
113  1  1  A  117  GLU  A  117  .  ?        ?  
114  1  1  A  118  THR  A  118  .  ?        ?  
115  1  1  A  119  PHE  A  119  .  ?        ?  
116  1  2  B    2  GLU  D  121  .  ?        ?  
117  1  2  B    3  ASP  D  122  .  ?        ?  
118  1  2  B    4  ASP  D  123  .  ?        ?  
119  1  2  B    5  TRP  D  124  .  ?        ?  
120  1  2  B    6  THR  D  125  .  ?        ?  
121  1  2  B    7  GLU  D  126  .  ?        ?  
122  1  2  B    8  PHE  D  127  .  ?        ?  
123  1  2  B    9  SER  D  128  .  ?        ?  
124  1  2  B   10  SER  D  129  .  ?        ?  
125  1  2  B   11  GLU  D  130  .  ?        ?  
126  1  2  B   12  GLU  D  131  .  ?        ?  
127  1  2  B   13  ILE  D  132  .  ?        ?  
128  1  2  B   14  ARG  D  133  .  ?        ?  
129  1  2  B   15  GLU  D  134  .  ?        ?  
130  1  2  B   16  ALA  D  135  .  ?        ?  
131  1  2  B   17  ARG  D  136  .  ?        ?  
132  1  3  C    .  ZN   A  201  .  ?        ?  
133  1  3  D    .  ZN   A  202  .  ?        ?  
134  1  3  E    .  ZN   A  203  .  ?        ?  
135  1  3  F    .  ZN   D  201  .  ?        ?  
136  1  4  G    .  HOH  A  301  .  ?        ?  
137  1  4  G    .  HOH  A  302  .  ?        ?  
138  1  4  G    .  HOH  A  303  .  ?        ?  
139  1  4  G    .  HOH  A  304  .  ?        ?  
140  1  4  G    .  HOH  A  305  .  ?        ?  
141  1  4  G    .  HOH  A  306  .  ?        ?  
142  1  4  G    .  HOH  A  307  .  ?        ?  
143  1  4  G    .  HOH  A  308  .  ?        ?  
144  1  4  G    .  HOH  A  309  .  ?        ?  
#
loop_
_pdbx_vrpt_model_instance_geometry.ordinal
_pdbx_vrpt_model_instance_geometry.instance_id
_pdbx_vrpt_model_instance_geometry.rotamer_class
_pdbx_vrpt_model_instance_geometry.phi
_pdbx_vrpt_model_instance_geometry.psi
_pdbx_vrpt_model_instance_geometry.ramachandran_class
_pdbx_vrpt_model_instance_geometry.num_H_reduce
_pdbx_vrpt_model_instance_geometry.OWAB
_pdbx_vrpt_model_instance_geometry.num_bonds_RMSZ
_pdbx_vrpt_model_instance_geometry.bonds_RMSZ
_pdbx_vrpt_model_instance_geometry.num_angles_RMSZ
_pdbx_vrpt_model_instance_geometry.angles_RMSZ
_pdbx_vrpt_model_instance_geometry.program_for_bond_angle_geometry
_pdbx_vrpt_model_instance_geometry.average_occupancy
  1    1  ?             ?      ?  ?           1   84.620     5  1.01     7  0.20  molprobity  1.000  
  2    2  p         -80.1  172.7  Favored     7   80.150     7  0.51    10  0.74  molprobity  1.000  
  3    3  t80       -55.5  -46.1  Favored     9   61.880    12  0.52    16  0.26  molprobity  1.000  
  4    4  mttt      -62.1  -32.0  Favored    13   69.650     9  0.30    11  0.38  molprobity  1.000  
  5    5  mt-30     -77.0  -42.7  Favored     8   80.170     9  0.28    12  0.41  molprobity  1.000  
  6    6  mtm105    -56.8  -68.7  Allowed    13   80.510    11  0.49    14  1.32  molprobity  1.000  
  7    7  mmm180    -89.6  139.2  Favored    13   83.130    11  0.54    14  1.12  molprobity  1.000  
  8    8  p         -68.5  170.9  Favored     5   61.750     6  0.43     8  0.36  molprobity  1.000  
  9    9  t80       -65.9  -48.4  Favored     9   54.030    12  0.53    16  0.38  molprobity  1.000  
 10   10  ?         -54.5  -42.1  Favored     2   59.820     5  0.61     7  0.53  molprobity  1.000  
 11   11  ?         -70.5  -36.5  Favored     2   54.730     5  0.19     7  0.33  molprobity  1.000  
 12   12  mtm180    -71.5  -40.5  Favored    13   55.940    11  0.38    14  1.74  molprobity  1.000  
 13   13  t         -63.0  -41.2  Favored     9   55.410     7  0.20    10  0.29  molprobity  1.000  
 14   14  mm-40     -61.0  -45.2  Favored     6   76.560     9  0.40    12  0.51  molprobity  1.000  
 15   15  m-20      -48.8  -53.8  Favored     4   63.790     8  0.44    11  0.69  molprobity  1.000  
 16   16  t         -63.1  -46.0  Favored     9   47.050     7  0.29    10  0.37  molprobity  1.000  
 17   17  ?         -55.5  -51.2  Favored     2   49.760     5  0.25     7  0.33  molprobity  1.000  
 18   18  mt        -59.0  -47.3  Favored    11   54.860     8  0.49    11  0.66  molprobity  1.000  
 19   19  tp        -70.0  -30.4  Favored    11   50.980     8  0.31    11  0.43  molprobity  1.000  
 20   20  mtp85     -85.1  -14.3  Favored    13   59.560    11  0.45    14  1.22  molprobity  1.000  
 21   21  ?         -63.3  -39.0  Favored     2   59.220     5  0.37     7  0.52  molprobity  1.000  
 22   22  mm-40     -82.1  -42.9  Favored     8   67.330     9  0.29    12  0.55  molprobity  1.000  
 23   23  m-70     -130.2   78.2  Favored     7   51.980    11  0.48    16  0.41  molprobity  1.000  
 24   24  Cg_exo    -61.6  -16.4  Favored     7   54.820     8  0.24    11  0.87  molprobity  1.000  
 25   25  p        -111.0   -5.1  Favored     7   53.590     7  0.30    10  0.84  molprobity  1.000  
 26   26  mttt      -90.6  148.2  Favored    13   54.550     9  0.28    11  0.37  molprobity  1.000  
 27   27  mm        -99.6  119.0  Favored    11   40.370     8  0.44    12  0.65  molprobity  1.000  
 28   28  Cg_endo   -77.8  109.8  Favored     7   37.590     8  0.35    11  0.43  molprobity  1.000  
 29   29  t        -117.4  131.8  Favored     9   42.180     7  0.29    10  0.57  molprobity  1.000  
 30   30  mm        -98.9  119.7  Favored    11   42.730     8  0.24    11  0.72  molprobity  1.000  
 31   31  mt       -119.1  119.8  Favored    11   47.610     8  0.24    11  0.73  molprobity  1.000  
 32   32  mt-10    -131.5  162.2  Favored     6   57.540     9  0.29    12  0.35  molprobity  1.000  
 33   33  ttp180    -85.4  142.2  Favored    13   51.620    11  0.33    14  0.67  molprobity  1.000  
 34   34  t80       -57.3  135.3  Favored     9   65.760    13  0.49    18  0.36  molprobity  1.000  
 35   35  ?         -51.7  -35.8  Favored     6   61.720     7  0.62     9  0.58  molprobity  1.000  
 36   36  ?         -85.5   -7.0  Favored     3   55.100     4  0.35     5  0.84  molprobity  1.000  
 37   37  tp10      -76.5  128.3  Favored     6   57.130     9  0.41    12  0.55  molprobity  1.000  
 38   38  ?        -108.7  -33.0  Favored     6   54.140     7  0.58     9  0.79  molprobity  1.000  
 39   39  tt0       -71.7  -48.5  Favored     8   46.020     9  0.57    12  0.63  molprobity  1.000  
 40   40  mt        -79.0  145.4  Favored    11   43.840     8  0.27    12  0.55  molprobity  1.000  
 41   41  Cg_endo   -80.9  153.7  Favored     7   43.570     8  0.33    11  0.35  molprobity  1.000  
 42   42  t         -69.5  139.8  Favored     9   51.930     7  0.19    10  0.62  molprobity  1.000  
 43   43  mt        -73.8  139.8  Favored    11   64.780     8  0.26    11  0.59  molprobity  1.000  
 44   44  p-10      -51.3  -44.3  Favored     4   70.630     8  0.78    11  1.13  molprobity  1.000  
 45   45  ?        -117.1  154.1  Favored     6   61.270     7  0.56     9  0.65  molprobity  1.000  
 46   46  m        -105.2  -45.3  Favored     7   59.200     7  0.63    10  0.94  molprobity  1.000  
 47   47  mtmt      -86.1  120.8  Favored    13   55.140     9  0.26    11  0.57  molprobity  1.000  
 48   48  m-85     -122.2  142.8  Favored     9   48.620    12  0.50    16  0.38  molprobity  1.000  
 49   49  mt       -108.6  124.7  Favored    11   47.830     8  0.38    11  1.13  molprobity  1.000  
 50   50  m        -126.5  144.7  Favored     9   48.020     7  0.38    11  0.86  molprobity  1.000  
 51   51  Cg_exo    -67.6  150.7  Favored     7   47.530     8  0.27    11  0.39  molprobity  1.000  
 52   52  p-10      -52.6  -33.5  Favored     4   50.720     8  0.57    11  0.96  molprobity  1.000  
 53   53  p-80      -90.4   -5.7  Favored     7   54.480    11  0.26    15  0.45  molprobity  1.000  
 54   54  t         -73.3  129.7  Favored     9   53.380     7  0.23    10  0.50  molprobity  1.000  
 55   55  p30       -94.0  173.3  Favored     6   50.240     8  0.51    11  0.61  molprobity  1.000  
 56   56  mmt       -67.1  -36.6  Favored     9   55.060     8  0.29    10  0.64  molprobity  1.000  
 57   57  p         -64.5  -37.8  Favored     5   55.410     6  0.43     8  0.42  molprobity  1.000  
 58   58  mt-10     -66.4  -41.1  Favored     6   60.760     9  0.43    12  0.51  molprobity  1.000  
 59   59  tp        -63.4  -44.8  Favored    11   50.640     8  0.35    11  0.42  molprobity  1.000  
 60   60  pp        -67.8  -36.5  Favored    11   58.890     8  0.33    11  0.68  molprobity  1.000  
 61   61  ?         -65.5  -34.9  Favored     6   50.980     7  0.24     9  0.47  molprobity  1.000  
 62   62  mt        -61.7  -53.1  Favored    11   54.420     8  0.29    11  0.63  molprobity  1.000  
 63   63  mt        -64.3  -38.6  Favored    11   54.210     8  0.20    11  0.34  molprobity  1.000  
 64   64  mtt-85    -57.1  -48.6  Favored    13   55.060    11  0.42    14  1.41  molprobity  1.000  
 65   65  ?         -63.1  -34.8  Favored     2   54.400     5  0.28     7  0.35  molprobity  1.000  
 66   66  mmm180    -65.7  -44.5  Favored    13   60.270    11  0.45    14  1.36  molprobity  1.000  
 67   67  mt        -84.7   -0.3  Favored    11   54.030     8  0.27    11  0.95  molprobity  1.000  
 68   68  mt-30      47.0   43.5  Favored     8   61.300     9  0.40    12  0.41  molprobity  1.000  
 69   69  OUTLIER   -65.1  138.8  Favored    11   56.480     8  0.32    11  0.90  molprobity  1.000  
 70   70  OUTLIER   -76.3  159.0  Favored     6   70.310     8  0.60    11  1.34  molprobity  1.000  
 71   71  ?         -56.6  -31.9  Favored     5   60.320     5  0.27     7  0.63  molprobity  1.000  
 72   72  m120      -79.0  -13.0  Favored     6   64.820     8  0.30    11  0.50  molprobity  1.000  
 73   73  mt-30     -73.4  135.6  Favored     8   53.880     9  0.25    12  0.24  molprobity  1.000  
 74   74  ?         -83.9  152.3  Favored     5   52.440     5  0.30     7  0.36  molprobity  1.000  
 75   75  t80      -147.4  115.0  Favored     9   47.470    12  0.49    16  0.36  molprobity  1.000  
 76   76  m-85     -120.3  145.5  Favored     9   48.480    12  0.48    16  0.25  molprobity  1.000  
 77   77  mt       -114.9  127.8  Favored    11   48.710     8  0.30    11  0.40  molprobity  1.000  
 78   78  tp       -109.3  125.9  Favored    11   45.540     8  0.25    11  0.37  molprobity  1.000  
 79   79  t        -108.5  136.9  Favored     9   43.700     7  0.30    10  0.45  molprobity  1.000  
 80   80  t30        54.9   28.7  Favored     6   43.740     8  0.54    11  0.41  molprobity  1.000  
 81   81  ?          75.8    5.0  Favored     3   43.640     4  0.57     5  1.01  molprobity  1.000  
 82   82  p-80     -160.7  -19.5  Allowed     7   41.510    11  0.45    15  0.91  molprobity  1.000  
 83   83  t        -100.2  123.8  Favored     5   48.410     6  0.29     8  0.59  molprobity  1.000  
 84   84  mmm      -113.1   90.2  Favored     9   66.710     8  0.30    10  0.87  molprobity  1.000  
 85   85  m         -79.3  160.8  Favored     9   61.640     7  0.40    10  0.74  molprobity  1.000  
 86   86  t         -56.1  135.4  Favored     5   57.130     6  0.23     8  0.23  molprobity  1.000  
 87   87  m         -67.7  -20.9  Favored     9   54.760     7  0.45    10  0.65  molprobity  1.000  
 88   88  t         -64.3  -18.8  Favored     5   57.480     6  0.52     8  0.84  molprobity  1.000  
 89   89  m         -70.2  128.0  Favored     7   47.960     7  0.31    11  0.91  molprobity  1.000  
 90   90  Cg_endo   -64.7  150.0  Favored     7   50.780     8  0.24    11  0.30  molprobity  1.000  
 91   91  tt        -67.3  -23.0  Favored    11   54.590     8  0.22    11  0.28  molprobity  1.000  
 92   92  p         -63.7  -37.5  Favored     5   50.150     6  0.28     8  0.36  molprobity  1.000  
 93   93  mm-40     -72.9  -35.4  Favored     6   50.820     9  0.44    12  0.40  molprobity  1.000  
 94   94  t         -61.7  -44.8  Favored     9   43.120     7  0.27    10  0.25  molprobity  1.000  
 95   95  t80       -60.5  -37.9  Favored     9   42.660    13  0.60    18  0.55  molprobity  1.000  
 96   96  tt0       -59.8  -44.1  Favored     6   54.630     9  0.26    12  0.52  molprobity  1.000  
 97   97  p         -97.2  -24.0  Favored     5   46.000     6  0.34     8  0.65  molprobity  1.000  
 98   98  mm-40    -123.2    2.8  Favored     6   39.720     9  0.67    12  0.93  molprobity  1.000  
 99   99  OUTLIER   -61.8  152.7  Favored    13   51.380    11  0.32    14  1.34  molprobity  1.000  
100  100  t70       -78.8  161.1  Favored     4   53.990     8  0.30    11  0.67  molprobity  1.000  
101  101  pm0       -51.8  -24.9  Favored     6   61.140     9  0.81    12  0.80  molprobity  1.000  
102  102  p30       -82.7  -10.8  Favored     4   50.360     8  0.62    11  0.87  molprobity  1.000  
103  103  ?         102.1  -11.8  Favored     3   44.940     4  0.32     5  0.55  molprobity  1.000  
104  104  m-85      -84.8  154.8  Favored     9   39.660    12  0.69    16  0.69  molprobity  1.000  
105  105  tp       -103.3  109.4  Favored    11   41.410     8  0.29    11  0.47  molprobity  1.000  
106  106  m-85      -88.0  134.5  Favored     9   42.090    13  0.37    18  0.44  molprobity  1.000  
107  107  mtp      -134.9  154.9  Favored     9   45.750     8  0.46    10  0.47  molprobity  1.000  
108  108  m        -133.4  148.0  Favored     9   44.120     7  0.31    10  0.68  molprobity  1.000  
109  109  p90      -117.9  158.4  Favored     9   47.720    13  0.34    18  0.74  molprobity  1.000  
110  110  ?        -163.5  172.4  Favored     5   45.310     5  0.30     7  0.52  molprobity  1.000  
111  111  p        -107.5    1.7  Favored     5   50.830     6  0.42     8  0.50  molprobity  1.000  
112  112  ?        -115.6  141.0  Favored     2   55.950     5  0.46     7  0.46  molprobity  1.000  
113  113  ?         -70.7  -20.4  Favored     2   69.170     5  0.56     7  0.56  molprobity  1.000  
114  114  p         -81.2  156.4  Favored     7   76.150     7  0.43    10  0.72  molprobity  1.000  
115  115  m-85          ?      ?  ?           9   61.240    11  0.75    13  0.30  molprobity  1.000  
116  116  ?             ?      ?  ?           1   99.220     5  0.89     7  0.55  molprobity  1.000  
117  117  ?        -111.9  135.8  Favored     2   92.470     5  0.27     7  0.42  molprobity  1.000  
118  118  OUTLIER   -75.7  -43.5  Favored     4   78.610     8  0.53    11  0.75  molprobity  1.000  
119  119  m95       -70.4  119.5  Favored    10   49.650    16  0.80    23  0.53  molprobity  1.000  
120  120  m        -114.4  112.5  Favored     7   51.980     7  0.34    10  0.52  molprobity  1.000  
121  121  mt-10     -99.0  143.8  Favored     6   49.850     9  0.48    12  0.54  molprobity  1.000  
122  122  m-85      -88.5  129.5  Favored     9   62.580    12  0.58    16  0.38  molprobity  1.000  
123  123  p         -70.6  166.2  Favored     5   59.000     6  0.29     8  0.41  molprobity  1.000  
124  124  m         -65.7  -41.6  Favored     5   60.290     6  0.34     8  0.39  molprobity  1.000  
125  125  tt0       -45.7  -55.2  Favored     6   77.220     9  0.62    12  0.55  molprobity  1.000  
126  126  tt0       -60.4  -43.4  Favored     6   65.600     9  0.27    12  0.38  molprobity  1.000  
127  127  mt        -68.1  -43.9  Favored    11   60.570     8  0.22    11  0.48  molprobity  1.000  
128  128  mtt85     -55.8  -50.3  Favored    13   75.410    11  0.65    14  1.40  molprobity  1.000  
129  129  mt-10     -60.0  -26.8  Favored     6   89.900     9  0.39    12  0.45  molprobity  1.000  
130  130  ?         -59.8  -52.7  Favored     5   90.870     5  0.35     7  0.38  molprobity  1.000  
131  131  mtt180        ?      ?  ?          13   91.180    10  0.54    11  1.15  molprobity  1.000  
132  132  ?             ?      ?  ?           ?   39.390     ?     ?     ?     ?  ?           1.000  
133  133  ?             ?      ?  ?           ?   80.150     ?     ?     ?     ?  ?           1.000  
134  134  ?             ?      ?  ?           ?   67.820     ?     ?     ?     ?  ?           1.000  
135  135  ?             ?      ?  ?           ?  148.880     ?     ?     ?     ?  ?           1.000  
136  136  ?             ?      ?  ?           ?   50.880     ?     ?     ?     ?  ?           1.000  
137  137  ?             ?      ?  ?           ?   52.080     ?     ?     ?     ?  ?           1.000  
138  138  ?             ?      ?  ?           ?   49.070     ?     ?     ?     ?  ?           1.000  
139  139  ?             ?      ?  ?           ?   56.600     ?     ?     ?     ?  ?           1.000  
140  140  ?             ?      ?  ?           ?   36.760     ?     ?     ?     ?  ?           1.000  
141  141  ?             ?      ?  ?           ?   56.080     ?     ?     ?     ?  ?           1.000  
142  142  ?             ?      ?  ?           ?   40.120     ?     ?     ?     ?  ?           0.470  
143  143  ?             ?      ?  ?           ?   32.590     ?     ?     ?     ?  ?           1.000  
144  144  ?             ?      ?  ?           ?   28.600     ?     ?     ?     ?  ?           1.000  
#
loop_
_pdbx_vrpt_instance_clashes.ordinal
_pdbx_vrpt_instance_clashes.instance_id
_pdbx_vrpt_instance_clashes.label_atom_id
_pdbx_vrpt_instance_clashes.cid
_pdbx_vrpt_instance_clashes.clashmag
_pdbx_vrpt_instance_clashes.dist
 1   20  NH1   1  0.41  2.53  
 2   26  O     1  0.41  2.53  
 3   32  O     2  0.40  2.21  
 4   50  HG21  3  0.57  1.87  
 5   50  CG2   4  0.47  2.45  
 6   50  CG2   5  0.43  2.49  
 7   60  HG22  6  0.56  1.88  
 8   60  CG2   7  0.43  2.48  
 9   64  NH2   8  0.76  2.18  
10   67  HB2   9  0.43  1.99  
11   69  HD13  9  0.43  1.99  
12   73  O     8  0.76  2.18  
13   77  HD12  6  0.56  1.88  
14   77  HD12  7  0.43  2.48  
15   91  HD13  3  0.57  1.87  
16   91  HD13  5  0.43  2.49  
17   91  HG21  4  0.47  2.45  
18  108  HA    2  0.40  2.21  
#
loop_
_pdbx_vrpt_model_instance_density.ordinal
_pdbx_vrpt_model_instance_density.instance_id
_pdbx_vrpt_model_instance_density.natoms_eds
_pdbx_vrpt_model_instance_density.RSRCC
_pdbx_vrpt_model_instance_density.RSR
_pdbx_vrpt_model_instance_density.RSRZ
  1    1   5  0.730  0.359   1.579  
  2    2   7  0.875  0.289   1.746  
  3    3  11  0.960  0.195   0.177  
  4    4   9  0.919  0.166  -0.621  
  5    5   9  0.871  0.344   1.871  
  6    6  11  0.842  0.312   1.343  
  7    7  11  0.878  0.301   1.206  
  8    8   6  0.947  0.138  -0.386  
  9    9  11  0.953  0.163  -0.284  
 10   10   5  0.912  0.201  -0.066  
 11   11   5  0.963  0.130  -0.814  
 12   12  11  0.950  0.150  -0.677  
 13   13   7  0.969  0.208   0.389  
 14   14   9  0.837  0.281   0.897  
 15   15   8  0.915  0.197   0.248  
 16   16   7  0.977  0.109  -1.063  
 17   17   5  0.956  0.088  -1.450  
 18   18   8  0.964  0.170  -0.308  
 19   19   8  0.980  0.158  -0.459  
 20   20  11  0.939  0.156  -0.602  
 21   21   5  0.927  0.102  -1.258  
 22   22   9  0.899  0.154  -0.513  
 23   23  10  0.972  0.111  -0.901  
 24   24   7  0.942  0.179   0.174  
 25   25   7  0.931  0.177   0.114  
 26   26   9  0.956  0.125  -1.089  
 27   27   8  0.971  0.154  -0.519  
 28   28   7  0.979  0.157  -0.142  
 29   29   7  0.983  0.185   0.051  
 30   30   8  0.985  0.158  -0.459  
 31   31   8  0.966  0.182  -0.104  
 32   32   9  0.897  0.156  -0.608  
 33   33  11  0.944  0.114  -1.126  
 34   34  12  0.883  0.166  -0.152  
 35   35   7  0.896  0.211  -0.108  
 36   36   4  0.973  0.155  -0.074  
 37   37   9  0.977  0.101  -1.270  
 38   38   7  0.952  0.112  -1.237  
 39   39   9  0.947  0.136  -0.739  
 40   40   8  0.977  0.093  -1.400  
 41   41   7  0.968  0.135  -0.459  
 42   42   7  0.977  0.126  -0.814  
 43   43   8  0.979  0.117  -1.060  
 44   44   8  0.902  0.135  -0.579  
 45   45   7  0.905  0.133  -0.998  
 46   46   7  0.949  0.131  -0.557  
 47   47   9  0.945  0.181  -0.450  
 48   48  11  0.980  0.154  -0.414  
 49   49   8  0.955  0.196   0.061  
 50   50   7  0.970  0.129  -0.770  
 51   51   7  0.946  0.132  -0.502  
 52   52   8  0.961  0.109  -0.927  
 53   53  10  0.904  0.136  -0.544  
 54   54   7  0.971  0.126  -0.814  
 55   55   8  0.926  0.141  -0.488  
 56   56   8  0.980  0.089  -1.237  
 57   57   6  0.962  0.133  -0.455  
 58   58   9  0.882  0.225   0.223  
 59   59   8  0.967  0.169  -0.322  
 60   60   8  0.928  0.227   0.563  
 61   61   7  0.969  0.136  -0.964  
 62   62   8  0.947  0.158  -0.459  
 63   63   8  0.957  0.147  -0.622  
 64   64  11  0.892  0.127  -0.964  
 65   65   5  0.944  0.120  -1.051  
 66   66  11  0.890  0.204  -0.004  
 67   67   8  0.966  0.168  -0.336  
 68   68   9  0.906  0.171  -0.300  
 69   69   8  0.955  0.176  -0.223  
 70   70   8  0.886  0.214   0.515  
 71   71   5  0.974  0.105  -0.897  
 72   72   8  0.894  0.202   0.350  
 73   73   9  0.958  0.105  -1.128  
 74   74   5  0.971  0.112  -0.796  
 75   75  11  0.955  0.098  -1.220  
 76   76  11  0.890  0.255   1.042  
 77   77   8  0.957  0.146  -0.648  
 78   78   8  0.974  0.147  -0.634  
 79   79   7  0.975  0.234   0.770  
 80   80   8  0.938  0.143  -0.460  
 81   81   4  0.947  0.107  -0.712  
 82   82  10  0.977  0.109  -0.930  
 83   83   6  0.962  0.153  -0.177  
 84   84   8  0.927  0.175   0.037  
 85   85   7  0.944  0.140  -0.609  
 86   86   6  0.959  0.112  -0.748  
 87   87   7  0.973  0.159  -0.330  
 88   88   6  0.881  0.134  -0.442  
 89   89   7  0.938  0.109  -0.878  
 90   90   7  0.964  0.118  -0.704  
 91   91   8  0.956  0.177  -0.178  
 92   92   6  0.973  0.121  -0.623  
 93   93   9  0.933  0.115  -1.101  
 94   94   7  0.975  0.139  -0.623  
 95   95  12  0.939  0.139  -0.564  
 96   96   9  0.955  0.122  -1.017  
 97   97   6  0.970  0.093  -1.013  
 98   98   9  0.983  0.107  -1.197  
 99   99  11  0.942  0.161  -0.540  
100  100   8  0.933  0.110  -0.913  
101  101   9  0.928  0.127  -0.957  
102  102   8  0.974  0.123  -0.740  
103  103   4  0.974  0.137  -0.313  
104  104  11  0.961  0.113  -1.004  
105  105   8  0.973  0.153  -0.549  
106  106  12  0.936  0.156  -0.305  
107  107   8  0.936  0.194   0.319  
108  108   7  0.977  0.174  -0.110  
109  109  12  0.965  0.114  -0.945  
110  110   5  0.954  0.124  -0.622  
111  111   6  0.902  0.137  -0.400  
112  112   5  0.927  0.155  -0.501  
113  113   5  0.869  0.171  -0.427  
114  114   7  0.925  0.200   0.449  
115  115  11  0.854  0.182  -0.010  
116  116   5  0.788  0.219   0.150  
117  117   5  0.881  0.164  -0.192  
118  118   8  0.844  0.162  -0.219  
119  119  14  0.954  0.136  -0.550  
120  120   7  0.958  0.119  -0.732  
121  121   9  0.971  0.129  -0.933  
122  122  11  0.949  0.164  -0.269  
123  123   6  0.933  0.087  -1.096  
124  124   6  0.975  0.128  -0.525  
125  125   9  0.812  0.253   0.560  
126  126   9  0.941  0.164  -0.511  
127  127   8  0.969  0.137  -0.770  
128  128  11  0.894  0.181  -0.291  
129  129   9  0.857  0.227   0.247  
130  130   5  0.846  0.172   0.072  
131  131  11  0.761  0.215   0.133  
132  132   1  0.997  0.084       ?  
133  133   1  0.985  0.043       ?  
134  134   1  0.984  0.037       ?  
135  135   1  0.867  0.295       ?  
136  136   1  0.989  0.077       ?  
137  137   1  0.946  0.424       ?  
138  138   1  0.908  0.150       ?  
139  139   1  0.907  0.185       ?  
140  140   1  0.952  0.175       ?  
141  141   1  0.967  0.075       ?  
142  142   1  0.932  0.307       ?  
143  143   1  0.924  0.193       ?  
144  144   1  0.754  0.239       ?  
#
loop_
_pdbx_vrpt_software.ordinal
_pdbx_vrpt_software.name
_pdbx_vrpt_software.version
_pdbx_vrpt_software.success_y_or_n
1  molprobity   4.02b-467                                                             Y  
2  mogul        unknown                                                               Y  
3  eds          2.36                                                                  Y  
4  dcc          '"2.27  (2023-04-10)"'                                                Y  
5  xtriage      1.13                                                                  Y  
6  percentiles  "20191225.v01 (using entries in the PDB archive December 25th 2019)"  Y  
##
